3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide

C10H19N3O — CID 131000731

IUPAC3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide
SMILESCN1CC2(CCN(CCC(N)=O)C2)C1
InChIInChI=1S/C10H19N3O/c1-12-6-10(7-12)3-5-13(8-10)4-2-9(11)14/h2-8H2,1H3,(H2,11,14)
InChIKeyZWPLDBOBZKMQNI-UHFFFAOYSA-N
MW197.28 g/mol
LogP-0.50
Rot. Bonds3

About 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide

3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide (PubChem CID 131000731) has the molecular formula C10H19N3O and a molecular weight of 197.28 g/mol. Its IUPAC name is 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide.

Molecular Properties

Compound Name3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide
PubChem CID131000731
Molecular FormulaC10H19N3O
Molecular Weight197.28 g/mol
Exact Mass197.15
IUPAC Name3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide
SMILESCN1CC2(CCN(CCC(N)=O)C2)C1
InChIInChI=1S/C10H19N3O/c1-12-6-10(7-12)3-5-13(8-10)4-2-9(11)14/h2-8H2,1H3,(H2,11,14)
InChIKeyZWPLDBOBZKMQNI-UHFFFAOYSA-N
XLogP-0.50
TPSA49.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 5-0.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide?
The IUPAC name of 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide (CID 131000731) is 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide.
What is the SMILES notation for 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide?
The canonical SMILES for 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide is CN1CC2(CCN(CCC(N)=O)C2)C1.
What is the InChIKey of 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide?
The InChIKey is ZWPLDBOBZKMQNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19N3O/c1-12-6-10(7-12)3-5-13(8-10)4-2-9(11)14/h2-8H2,1H3,(H2,11,14).
What are the key properties of 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide?
3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide has a molecular weight of 197.28 g/mol, XLogP of -0.50, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methyl-2,6-diazaspiro[3.4]octan-6-yl)propanamide is sourced from PubChem (CID 131000731), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).